(2-benzamido-2-oxidanylidene-ethyl) 4-(methylamino)-3-nitro-benzoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 4-(methylamino)-3-nitro-benzoate Openeye Name: (2-benzamido-2-oxo-ethyl) 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid (2-benzamido-2-keto-ethyl) ester Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC(=O)NC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O6/c1-18-13-8-7-12(9-14(13)20(24)25)17(23)26-10-15(21)19-16(22)11-5-3-2-4-6-11/h2-9,18H,10H2,1H3,(H,19,21,22)